SCHEMBL8236356

SCHEMBL8236356

Cc1nc(-c2nc3n(c2-c2ccc4ncnn4c2)CCc2ccccc2-3)ccc1F

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.51
MAPK14 Q16539 10/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8236655 0.90 TGFBR1 (0.50) TGFBR1MAPK14
SCHEMBL4791364 0.82 TGFBR1 (0.52) TGFBR1MAPK14
SCHEMBL8237303 0.76 TGFBR1 (0.59) TGFBR1
SCHEMBL2799154 0.75 TGFBR1 (0.47) TGFBR1MAPK14
SCHEMBL8236653 0.74 TGFBR1 (0.60) TGFBR1MAPK14
SCHEMBL8238164 0.74 TGFBR1 (0.57) TGFBR1MAPK14
SCHEMBL13232315 0.73 TGFBR1 (0.47) TGFBR1MAPK14
SCHEMBL8229446 0.73 TGFBR1 (0.58) TGFBR1MAPK14
SCHEMBL2802563 0.72 TGFBR1 (0.58) TGFBR1MAPK14
SCHEMBL4011848 0.71 TGFBR1 (0.55) TGFBR1MAPK14

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007076127-A2 CONDENSED IMIDAZOLES OR PYRAZOLES AND THEIR USE AS TRANSFORMING GROWTH FACTOR MODULATORS BIOGEN IDEC MA INC (US) 2007-07-05 WO disclosed